ChemSpider 2D Image | Ethyl 5-(2-hydroxy-2-propanyl)-1,2-oxazole-3-carboxylate | C9H13NO4

Ethyl 5-(2-hydroxy-2-propanyl)-1,2-oxazole-3-carboxylate

  • Molecular FormulaC9H13NO4
  • Average mass199.204 Da
  • Monoisotopic mass199.084457 Da
  • ChemSpider ID21475821

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-Isoxazolecarboxylic acid, 5-(1-hydroxy-1-methylethyl)-, ethyl ester [ACD/Index Name]
5-(2-Hydroxy-2-propanyl)-1,2-oxazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-(2-hydroxy-2-propanyl)-1,2-oxazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-5-(2-hydroxy-2-propanyl)-1,2-oxazol-3-carboxylat [German] [ACD/IUPAC Name]
5-(1-Hydroxy-1-methyl-ethyl)-isoxazole-3-carboxylic acid ethyl ester
861136-16-5 [RN]
Ethyl 5-(1-hydroxy-1-methylethyl)-3-isoxazolecarboxylate
ethyl 5-(1-hydroxy-1-methylethyl)isoxazole-3-carboxylate
ethyl 5-(1-hydroxy-isopropyl)isoxazole-3-carboxylate
ethyl 5-(2-hydroxypropan-2-yl)-1,2-oxazole-3-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 332.6±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.7±3.0 kJ/mol
Flash Point: 155.0±25.1 °C
Index of Refraction: 1.489
Molar Refractivity: 48.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.10
ACD/LogD (pH 5.5): 0.66
ACD/BCF (pH 5.5): 1.87
ACD/KOC (pH 5.5): 54.48
ACD/LogD (pH 7.4): 0.66
ACD/BCF (pH 7.4): 1.87
ACD/KOC (pH 7.4): 54.48
Polar Surface Area: 73 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 167.5±3.0 cm3

Click to predict properties on the Chemicalize site


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